2,2-dimethyl-5-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)-N-propylcyclopentan-1-amine

C18H35N3 — CID 79865651

IUPAC2,2-dimethyl-5-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)-N-propylcyclopentan-1-amine
SMILESCCCNC1C(N2CCC3CCC(C2)N3C)CCC1(C)C
InChIInChI=1S/C18H35N3/c1-5-11-19-17-16(8-10-18(17,2)3)21-12-9-14-6-7-15(13-21)20(14)4/h14-17,19H,5-13H2,1-4H3
InChIKeyORIZGFWKGWGPOI-UHFFFAOYSA-N
MW293.50 g/mol
LogP2.71
Rot. Bonds4

About 2,2-dimethyl-5-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)-N-propylcyclopentan-1-amine

2,2-dimethyl-5-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)-N-propylcyclopentan-1-amine (PubChem CID 79865651) has the molecular formula C18H35N3 and a molecular weight of 293.50 g/mol. Its IUPAC name is 2,2-dimethyl-5-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)-N-propylcyclopentan-1-amine.

Molecular Properties

Compound Name2,2-dimethyl-5-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)-N-propylcyclopentan-1-amine
PubChem CID79865651
Molecular FormulaC18H35N3
Molecular Weight293.50 g/mol
Exact Mass293.28
IUPAC Name2,2-dimethyl-5-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)-N-propylcyclopentan-1-amine
SMILESCCCNC1C(N2CCC3CCC(C2)N3C)CCC1(C)C
InChIInChI=1S/C18H35N3/c1-5-11-19-17-16(8-10-18(17,2)3)21-12-9-14-6-7-15(13-21)20(14)4/h14-17,19H,5-13H2,1-4H3
InChIKeyORIZGFWKGWGPOI-UHFFFAOYSA-N
XLogP2.71
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.50
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2,2-dimethyl-5-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)-N-propylcyclopentan-1-amine with MolForge

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Related Compounds

N-ethyl-2,2-dimethyl-5-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)cyclopentan-1-amine
CID 79860748
5-(azocan-1-yl)-2,2-dimethyl-N-propylcyclopentan-1-amine
CID 79865020
2-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)-N-propylcyclopentan-1-amine
CID 79174695
6-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-2,2-dimethyl-N-propylcyclohexan-1-amine
CID 79927085
2,2-dimethyl-5-[4-(2-methylpropyl)piperazin-1-yl]-N-propylcyclopentan-1-amine
CID 79865531
5-[4-(methoxymethyl)piperidin-1-yl]-2,2-dimethyl-N-propylcyclopentan-1-amine
CID 79860162
5-(2,2-dimethylpyrrolidin-1-yl)-2,2-dimethyl-N-propylcyclopentan-1-amine
CID 79859592
3-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)-N-propylcyclohexan-1-amine
CID 79618741
2,2-dimethyl-N-propyl-6-(4-propylpiperazin-1-yl)cyclohexan-1-amine
CID 79835810
1-[3,3-dimethyl-2-(propylamino)cyclohexyl]-N,N-dimethylpiperidin-4-amine
CID 79835828
2,2-dimethyl-6-(4-propan-2-ylpiperazin-1-yl)-N-propylcyclohexan-1-amine
CID 79835826
5-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl)-N-ethyl-2,2-dimethylcyclopentan-1-amine
CID 79863853

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-5-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)-N-propylcyclopentan-1-amine?
The IUPAC name of 2,2-dimethyl-5-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)-N-propylcyclopentan-1-amine (CID 79865651) is 2,2-dimethyl-5-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)-N-propylcyclopentan-1-amine.
What is the SMILES notation for 2,2-dimethyl-5-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)-N-propylcyclopentan-1-amine?
The canonical SMILES for 2,2-dimethyl-5-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)-N-propylcyclopentan-1-amine is CCCNC1C(N2CCC3CCC(C2)N3C)CCC1(C)C.
What is the InChIKey of 2,2-dimethyl-5-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)-N-propylcyclopentan-1-amine?
The InChIKey is ORIZGFWKGWGPOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H35N3/c1-5-11-19-17-16(8-10-18(17,2)3)21-12-9-14-6-7-15(13-21)20(14)4/h14-17,19H,5-13H2,1-4H3.
What are the key properties of 2,2-dimethyl-5-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)-N-propylcyclopentan-1-amine?
2,2-dimethyl-5-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)-N-propylcyclopentan-1-amine has a molecular weight of 293.50 g/mol, XLogP of 2.71, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-5-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)-N-propylcyclopentan-1-amine is sourced from PubChem (CID 79865651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).