1,5-dimethyl-N-propan-2-yl-N-(pyrrolidin-2-ylmethyl)pyrrolidin-3-amine

C14H29N3 — CID 106603013

IUPAC1,5-dimethyl-N-propan-2-yl-N-(pyrrolidin-2-ylmethyl)pyrrolidin-3-amine
SMILESCC1CC(N(CC2CCCN2)C(C)C)CN1C
InChIInChI=1S/C14H29N3/c1-11(2)17(9-13-6-5-7-15-13)14-8-12(3)16(4)10-14/h11-15H,5-10H2,1-4H3
InChIKeyXRBZWSIZFMKOPS-UHFFFAOYSA-N
MW239.41 g/mol
LogP1.54
Rot. Bonds4

About 1,5-dimethyl-N-propan-2-yl-N-(pyrrolidin-2-ylmethyl)pyrrolidin-3-amine

1,5-dimethyl-N-propan-2-yl-N-(pyrrolidin-2-ylmethyl)pyrrolidin-3-amine (PubChem CID 106603013) has the molecular formula C14H29N3 and a molecular weight of 239.41 g/mol. Its IUPAC name is 1,5-dimethyl-N-propan-2-yl-N-(pyrrolidin-2-ylmethyl)pyrrolidin-3-amine.

Molecular Properties

Compound Name1,5-dimethyl-N-propan-2-yl-N-(pyrrolidin-2-ylmethyl)pyrrolidin-3-amine
PubChem CID106603013
Molecular FormulaC14H29N3
Molecular Weight239.41 g/mol
Exact Mass239.24
IUPAC Name1,5-dimethyl-N-propan-2-yl-N-(pyrrolidin-2-ylmethyl)pyrrolidin-3-amine
SMILESCC1CC(N(CC2CCCN2)C(C)C)CN1C
InChIInChI=1S/C14H29N3/c1-11(2)17(9-13-6-5-7-15-13)14-8-12(3)16(4)10-14/h11-15H,5-10H2,1-4H3
InChIKeyXRBZWSIZFMKOPS-UHFFFAOYSA-N
XLogP1.54
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.41
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

8-methyl-N-(piperidin-2-ylmethyl)-N-propan-2-yl-8-azabicyclo[3.2.1]octan-3-amine
CID 106621974
N,3-di(propan-2-yl)-N-(pyrrolidin-2-ylmethyl)cyclohexan-1-amine
CID 107449580
N-(piperidin-2-ylmethyl)-N-propan-2-yloxetan-3-amine
CID 176601027
N-(piperidin-2-ylmethyl)-N-propan-2-yloxolan-3-amine
CID 106622294
1-ethyl-N-(piperidin-2-ylmethyl)-N-propan-2-ylpiperidin-4-amine
CID 106622124
4,4-dimethyl-N-(piperidin-2-ylmethyl)-N-propan-2-ylcyclohexan-1-amine
CID 106622300
2,2-dimethyl-N-(piperidin-2-ylmethyl)-N-propan-2-yloxan-4-amine
CID 106622299
N-(piperidin-2-ylmethyl)-N-propan-2-yl-1,2,3,5,6,7,8,8a-octahydroindolizin-7-amine
CID 106622307
3,3,5-trimethyl-N-(piperidin-2-ylmethyl)-N-propan-2-ylcyclohexan-1-amine
CID 106622016
N-(piperidin-2-ylmethyl)-N-propan-2-yl-5-oxaspiro[3.5]nonan-8-amine
CID 106632077
N-methyl-N-[[(2R)-pyrrolidin-2-yl]methyl]propan-2-amine;molecular hydrogen
CID 177210581
N-but-3-yn-2-yl-N-(pyrrolidin-2-ylmethyl)cyclopropanamine
CID 106599994

Frequently Asked Questions

What is the IUPAC name of 1,5-dimethyl-N-propan-2-yl-N-(pyrrolidin-2-ylmethyl)pyrrolidin-3-amine?
The IUPAC name of 1,5-dimethyl-N-propan-2-yl-N-(pyrrolidin-2-ylmethyl)pyrrolidin-3-amine (CID 106603013) is 1,5-dimethyl-N-propan-2-yl-N-(pyrrolidin-2-ylmethyl)pyrrolidin-3-amine.
What is the SMILES notation for 1,5-dimethyl-N-propan-2-yl-N-(pyrrolidin-2-ylmethyl)pyrrolidin-3-amine?
The canonical SMILES for 1,5-dimethyl-N-propan-2-yl-N-(pyrrolidin-2-ylmethyl)pyrrolidin-3-amine is CC1CC(N(CC2CCCN2)C(C)C)CN1C.
What is the InChIKey of 1,5-dimethyl-N-propan-2-yl-N-(pyrrolidin-2-ylmethyl)pyrrolidin-3-amine?
The InChIKey is XRBZWSIZFMKOPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3/c1-11(2)17(9-13-6-5-7-15-13)14-8-12(3)16(4)10-14/h11-15H,5-10H2,1-4H3.
What are the key properties of 1,5-dimethyl-N-propan-2-yl-N-(pyrrolidin-2-ylmethyl)pyrrolidin-3-amine?
1,5-dimethyl-N-propan-2-yl-N-(pyrrolidin-2-ylmethyl)pyrrolidin-3-amine has a molecular weight of 239.41 g/mol, XLogP of 1.54, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5-dimethyl-N-propan-2-yl-N-(pyrrolidin-2-ylmethyl)pyrrolidin-3-amine is sourced from PubChem (CID 106603013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).