N-[[1-(aminomethyl)cyclopropyl]methyl]-3,3-dimethylcyclopentan-1-amine

C12H24N2 — CID 114547571

IUPACN-[[1-(aminomethyl)cyclopropyl]methyl]-3,3-dimethylcyclopentan-1-amine
SMILESCC1(C)CCC(NCC2(CN)CC2)C1
InChIInChI=1S/C12H24N2/c1-11(2)4-3-10(7-11)14-9-12(8-13)5-6-12/h10,14H,3-9,13H2,1-2H3
InChIKeyPWOVLENFWOHGIR-UHFFFAOYSA-N
MW196.34 g/mol
LogP1.89
Rot. Bonds4

About N-[[1-(aminomethyl)cyclopropyl]methyl]-3,3-dimethylcyclopentan-1-amine

N-[[1-(aminomethyl)cyclopropyl]methyl]-3,3-dimethylcyclopentan-1-amine (PubChem CID 114547571) has the molecular formula C12H24N2 and a molecular weight of 196.34 g/mol. Its IUPAC name is N-[[1-(aminomethyl)cyclopropyl]methyl]-3,3-dimethylcyclopentan-1-amine.

Molecular Properties

Compound NameN-[[1-(aminomethyl)cyclopropyl]methyl]-3,3-dimethylcyclopentan-1-amine
PubChem CID114547571
Molecular FormulaC12H24N2
Molecular Weight196.34 g/mol
Exact Mass196.19
IUPAC NameN-[[1-(aminomethyl)cyclopropyl]methyl]-3,3-dimethylcyclopentan-1-amine
SMILESCC1(C)CCC(NCC2(CN)CC2)C1
InChIInChI=1S/C12H24N2/c1-11(2)4-3-10(7-11)14-9-12(8-13)5-6-12/h10,14H,3-9,13H2,1-2H3
InChIKeyPWOVLENFWOHGIR-UHFFFAOYSA-N
XLogP1.89
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.34
LogP ≤ 51.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3,3-dimethyl-N-[(4-methylpiperidin-4-yl)methyl]cyclopentan-1-amine
CID 114547529
1-N-(3,3-dimethylcyclopentyl)butane-1,2-diamine
CID 114547491
3,3-dimethyl-N-propylcyclopentan-1-amine
CID 20709207
1-[[(3,3-dimethylcyclopentyl)amino]methyl]-3-methylcyclohexan-1-amine
CID 114547425
N-[[1-(aminomethyl)-4-methylcyclohexyl]methyl]cyclobutanamine
CID 115442724
4-[[(3,3-dimethylcyclopentyl)amino]methyl]cyclopent-2-en-1-amine
CID 114547597
[1-[[(3,3-dimethylcyclohexyl)amino]methyl]cyclohexyl]methanol
CID 81435372
N-[(1-amino-3-ethoxy-2,2-dimethylcyclobutyl)methyl]-3,3-dimethylcyclopentan-1-amine
CID 114830821
N-[[1-(aminomethyl)-4-methylcyclohexyl]methyl]-3-methylcyclopentan-1-amine
CID 114547350
1-(aminomethyl)-N-(3,3-dimethylcyclopentyl)-3,5-dimethylcyclohexan-1-amine
CID 114544947
4-[[(3,3-dimethylcyclopentyl)amino]methyl]-2-fluoroaniline
CID 114547589
4-(aminomethyl)-N-(3,3-dimethylcyclopentyl)oxan-4-amine
CID 114544886

Frequently Asked Questions

What is the IUPAC name of N-[[1-(aminomethyl)cyclopropyl]methyl]-3,3-dimethylcyclopentan-1-amine?
The IUPAC name of N-[[1-(aminomethyl)cyclopropyl]methyl]-3,3-dimethylcyclopentan-1-amine (CID 114547571) is N-[[1-(aminomethyl)cyclopropyl]methyl]-3,3-dimethylcyclopentan-1-amine.
What is the SMILES notation for N-[[1-(aminomethyl)cyclopropyl]methyl]-3,3-dimethylcyclopentan-1-amine?
The canonical SMILES for N-[[1-(aminomethyl)cyclopropyl]methyl]-3,3-dimethylcyclopentan-1-amine is CC1(C)CCC(NCC2(CN)CC2)C1.
What is the InChIKey of N-[[1-(aminomethyl)cyclopropyl]methyl]-3,3-dimethylcyclopentan-1-amine?
The InChIKey is PWOVLENFWOHGIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2/c1-11(2)4-3-10(7-11)14-9-12(8-13)5-6-12/h10,14H,3-9,13H2,1-2H3.
What are the key properties of N-[[1-(aminomethyl)cyclopropyl]methyl]-3,3-dimethylcyclopentan-1-amine?
N-[[1-(aminomethyl)cyclopropyl]methyl]-3,3-dimethylcyclopentan-1-amine has a molecular weight of 196.34 g/mol, XLogP of 1.89, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(aminomethyl)cyclopropyl]methyl]-3,3-dimethylcyclopentan-1-amine is sourced from PubChem (CID 114547571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).