1-(aminomethyl)-N,N-bis[3-(dimethylamino)propyl]cyclopropane-1-carboxamide

C15H32N4O — CID 115452941

IUPAC1-(aminomethyl)-N,N-bis[3-(dimethylamino)propyl]cyclopropane-1-carboxamide
SMILESCN(C)CCCN(CCCN(C)C)C(=O)C1(CN)CC1
InChIInChI=1S/C15H32N4O/c1-17(2)9-5-11-19(12-6-10-18(3)4)14(20)15(13-16)7-8-15/h5-13,16H2,1-4H3
InChIKeyKHUYSVBAIWKLLC-UHFFFAOYSA-N
MW284.45 g/mol
LogP0.46
Rot. Bonds10

About 1-(aminomethyl)-N,N-bis[3-(dimethylamino)propyl]cyclopropane-1-carboxamide

1-(aminomethyl)-N,N-bis[3-(dimethylamino)propyl]cyclopropane-1-carboxamide (PubChem CID 115452941) has the molecular formula C15H32N4O and a molecular weight of 284.45 g/mol. Its IUPAC name is 1-(aminomethyl)-N,N-bis[3-(dimethylamino)propyl]cyclopropane-1-carboxamide.

Molecular Properties

Compound Name1-(aminomethyl)-N,N-bis[3-(dimethylamino)propyl]cyclopropane-1-carboxamide
PubChem CID115452941
Molecular FormulaC15H32N4O
Molecular Weight284.45 g/mol
Exact Mass284.26
IUPAC Name1-(aminomethyl)-N,N-bis[3-(dimethylamino)propyl]cyclopropane-1-carboxamide
SMILESCN(C)CCCN(CCCN(C)C)C(=O)C1(CN)CC1
InChIInChI=1S/C15H32N4O/c1-17(2)9-5-11-19(12-6-10-18(3)4)14(20)15(13-16)7-8-15/h5-13,16H2,1-4H3
InChIKeyKHUYSVBAIWKLLC-UHFFFAOYSA-N
XLogP0.46
TPSA52.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.45
LogP ≤ 50.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(aminomethyl)-N-[3-(dimethylamino)propyl]-N-(2-methoxyethyl)cyclopropane-1-carboxamide
CID 113312882
1-(aminomethyl)-N-[3-(dimethylamino)propyl]-N-(2-methoxyethyl)cyclopentane-1-carboxamide
CID 115435074
1-(aminomethyl)-N-heptyl-N-(3-hydroxypropyl)cyclopentane-1-carboxamide
CID 115435070
1-(aminomethyl)-N-[3-(dimethylamino)propyl]cyclopropane-1-carboxamide
CID 80587383
1-(aminomethyl)-N-[2-(dimethylamino)ethyl]-N-methylcyclopentane-1-carboxamide
CID 63695176
1-(aminomethyl)-N-butyl-N-(2,2,2-trifluoroethyl)cyclopropane-1-carboxamide
CID 113312851
1-(aminomethyl)-N-hexyl-N-(2-hydroxyethyl)cyclopentane-1-carboxamide
CID 115435051
1-(aminomethyl)-N,N-dimethylcyclopentane-1-carboxamide
CID 54593229
1-amino-N-[3-(dimethylamino)propyl]-N-methylcyclopropane-1-carboxamide
CID 65458413
1-(aminomethyl)-N-ethyl-N-(2-ethylbutyl)cyclopropane-1-carboxamide
CID 80587791
N-[3-(dimethylamino)propyl]-3-ethyl-N-(2-methoxyethyl)pyrrolidine-3-carboxamide
CID 63143867
4-(aminomethyl)-N,N-bis(2-methoxyethyl)oxane-4-carboxamide;hydrochloride
CID 120917290

Frequently Asked Questions

What is the IUPAC name of 1-(aminomethyl)-N,N-bis[3-(dimethylamino)propyl]cyclopropane-1-carboxamide?
The IUPAC name of 1-(aminomethyl)-N,N-bis[3-(dimethylamino)propyl]cyclopropane-1-carboxamide (CID 115452941) is 1-(aminomethyl)-N,N-bis[3-(dimethylamino)propyl]cyclopropane-1-carboxamide.
What is the SMILES notation for 1-(aminomethyl)-N,N-bis[3-(dimethylamino)propyl]cyclopropane-1-carboxamide?
The canonical SMILES for 1-(aminomethyl)-N,N-bis[3-(dimethylamino)propyl]cyclopropane-1-carboxamide is CN(C)CCCN(CCCN(C)C)C(=O)C1(CN)CC1.
What is the InChIKey of 1-(aminomethyl)-N,N-bis[3-(dimethylamino)propyl]cyclopropane-1-carboxamide?
The InChIKey is KHUYSVBAIWKLLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N4O/c1-17(2)9-5-11-19(12-6-10-18(3)4)14(20)15(13-16)7-8-15/h5-13,16H2,1-4H3.
What are the key properties of 1-(aminomethyl)-N,N-bis[3-(dimethylamino)propyl]cyclopropane-1-carboxamide?
1-(aminomethyl)-N,N-bis[3-(dimethylamino)propyl]cyclopropane-1-carboxamide has a molecular weight of 284.45 g/mol, XLogP of 0.46, 10 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(aminomethyl)-N,N-bis[3-(dimethylamino)propyl]cyclopropane-1-carboxamide is sourced from PubChem (CID 115452941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).