N-(pyrrolidin-3-ylmethyl)hexan-2-amine

C11H24N2 — CID 63006351

IUPACN-(pyrrolidin-3-ylmethyl)hexan-2-amine
SMILESCCCCC(C)NCC1CCNC1
InChIInChI=1S/C11H24N2/c1-3-4-5-10(2)13-9-11-6-7-12-8-11/h10-13H,3-9H2,1-2H3
InChIKeyBVXCNOJMEOMACZ-UHFFFAOYSA-N
MW184.33 g/mol
LogP1.76
Rot. Bonds6

About N-(pyrrolidin-3-ylmethyl)hexan-2-amine

N-(pyrrolidin-3-ylmethyl)hexan-2-amine (PubChem CID 63006351) has the molecular formula C11H24N2 and a molecular weight of 184.33 g/mol. Its IUPAC name is N-(pyrrolidin-3-ylmethyl)hexan-2-amine.

Molecular Properties

Compound NameN-(pyrrolidin-3-ylmethyl)hexan-2-amine
PubChem CID63006351
Molecular FormulaC11H24N2
Molecular Weight184.33 g/mol
Exact Mass184.19
IUPAC NameN-(pyrrolidin-3-ylmethyl)hexan-2-amine
SMILESCCCCC(C)NCC1CCNC1
InChIInChI=1S/C11H24N2/c1-3-4-5-10(2)13-9-11-6-7-12-8-11/h10-13H,3-9H2,1-2H3
InChIKeyBVXCNOJMEOMACZ-UHFFFAOYSA-N
XLogP1.76
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.33
LogP ≤ 51.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(pyrrolidin-3-ylmethyl)pentan-2-amine
CID 107886815
N-(piperidin-3-ylmethyl)pentan-2-amine
CID 80553041
(2S)-2-[[(3S)-pyrrolidin-3-yl]methylamino]propan-1-ol;sulfane
CID 160904644
5-methyl-N-(piperidin-3-ylmethyl)hexan-2-amine
CID 80553387
N-(cyclobutylmethyl)octan-2-amine
CID 43298239
N-[(4-methylcyclohexyl)methyl]nonan-2-amine
CID 63464065
ethane;N'-[(2S,5R)-5-methylheptan-2-yl]-N-[[(3S)-pyrrolidin-3-yl]methyl]ethane-1,2-diamine
CID 177134730
N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]hexan-2-amine
CID 61207933
N-(piperidin-2-ylmethyl)hexan-2-amine
CID 62199509
N-[(1-propylpyrrolidin-3-yl)methyl]hexan-2-amine
CID 115712049
N-(pyrrolidin-3-ylmethyl)propan-1-amine
CID 13491799
N-(2-piperidin-4-ylsulfanylethyl)hexan-2-amine
CID 114628548

Frequently Asked Questions

What is the IUPAC name of N-(pyrrolidin-3-ylmethyl)hexan-2-amine?
The IUPAC name of N-(pyrrolidin-3-ylmethyl)hexan-2-amine (CID 63006351) is N-(pyrrolidin-3-ylmethyl)hexan-2-amine.
What is the SMILES notation for N-(pyrrolidin-3-ylmethyl)hexan-2-amine?
The canonical SMILES for N-(pyrrolidin-3-ylmethyl)hexan-2-amine is CCCCC(C)NCC1CCNC1.
What is the InChIKey of N-(pyrrolidin-3-ylmethyl)hexan-2-amine?
The InChIKey is BVXCNOJMEOMACZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2/c1-3-4-5-10(2)13-9-11-6-7-12-8-11/h10-13H,3-9H2,1-2H3.
What are the key properties of N-(pyrrolidin-3-ylmethyl)hexan-2-amine?
N-(pyrrolidin-3-ylmethyl)hexan-2-amine has a molecular weight of 184.33 g/mol, XLogP of 1.76, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(pyrrolidin-3-ylmethyl)hexan-2-amine is sourced from PubChem (CID 63006351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).