N-[2-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]ethyl]cyclopropanamine

C12H25N3 — CID 62886265

IUPACN-[2-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]ethyl]cyclopropanamine
SMILESCN(C)CC1CCCN1CCNC1CC1
InChIInChI=1S/C12H25N3/c1-14(2)10-12-4-3-8-15(12)9-7-13-11-5-6-11/h11-13H,3-10H2,1-2H3
InChIKeyFSADRLXVWQARTR-UHFFFAOYSA-N
MW211.35 g/mol
LogP0.76
Rot. Bonds6

About N-[2-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]ethyl]cyclopropanamine

N-[2-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]ethyl]cyclopropanamine (PubChem CID 62886265) has the molecular formula C12H25N3 and a molecular weight of 211.35 g/mol. Its IUPAC name is N-[2-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]ethyl]cyclopropanamine.

Molecular Properties

Compound NameN-[2-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]ethyl]cyclopropanamine
PubChem CID62886265
Molecular FormulaC12H25N3
Molecular Weight211.35 g/mol
Exact Mass211.20
IUPAC NameN-[2-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]ethyl]cyclopropanamine
SMILESCN(C)CC1CCCN1CCNC1CC1
InChIInChI=1S/C12H25N3/c1-14(2)10-12-4-3-8-15(12)9-7-13-11-5-6-11/h11-13H,3-10H2,1-2H3
InChIKeyFSADRLXVWQARTR-UHFFFAOYSA-N
XLogP0.76
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.35
LogP ≤ 50.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-N-methylbutan-2-amine
CID 62886637
N-[2-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]ethyl]-4-ethoxybutan-1-amine
CID 62887865
2-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-N-(oxolan-2-ylmethyl)ethanamine
CID 62887699
4-[2-[(dimethylamino)methyl]piperidin-1-yl]-N-methylbutan-1-amine
CID 19846007
3-(cyclopropylamino)-N-[(1-ethylpyrrolidin-2-yl)methyl]-N-methylpropanamide
CID 79313512
1-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-N-methylpropan-2-amine
CID 62886469
N-[[4-[[2-[(dimethylamino)methyl]pyrrolidin-1-yl]methyl]oxan-4-yl]methyl]cyclopropanamine
CID 62889036
hydrazinyl 3-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]propanoate
CID 66337122
N-[2-(2,3-dimethylpiperidin-1-yl)ethyl]-4-methylcyclohexan-1-amine
CID 55090112
N-cyclopropyl-N'-methyl-N'-[(1-methylpiperidin-3-yl)methyl]ethane-1,2-diamine
CID 115207045
1-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-4,4-dimethylpentan-3-amine
CID 62889374
1-N-cyclopropyl-2-N-[(1-ethylpyrrolidin-2-yl)methyl]-2-N-methylbutane-1,2-diamine
CID 79312570

Frequently Asked Questions

What is the IUPAC name of N-[2-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]ethyl]cyclopropanamine?
The IUPAC name of N-[2-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]ethyl]cyclopropanamine (CID 62886265) is N-[2-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]ethyl]cyclopropanamine.
What is the SMILES notation for N-[2-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]ethyl]cyclopropanamine?
The canonical SMILES for N-[2-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]ethyl]cyclopropanamine is CN(C)CC1CCCN1CCNC1CC1.
What is the InChIKey of N-[2-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]ethyl]cyclopropanamine?
The InChIKey is FSADRLXVWQARTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3/c1-14(2)10-12-4-3-8-15(12)9-7-13-11-5-6-11/h11-13H,3-10H2,1-2H3.
What are the key properties of N-[2-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]ethyl]cyclopropanamine?
N-[2-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]ethyl]cyclopropanamine has a molecular weight of 211.35 g/mol, XLogP of 0.76, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]ethyl]cyclopropanamine is sourced from PubChem (CID 62886265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).