N-methyl-N-[2-[3-[(propan-2-ylamino)methyl]pyrrolidin-1-yl]ethyl]cyclopropanamine

C14H29N3 — CID 62975746

IUPACN-methyl-N-[2-[3-[(propan-2-ylamino)methyl]pyrrolidin-1-yl]ethyl]cyclopropanamine
SMILESCC(C)NCC1CCN(CCN(C)C2CC2)C1
InChIInChI=1S/C14H29N3/c1-12(2)15-10-13-6-7-17(11-13)9-8-16(3)14-4-5-14/h12-15H,4-11H2,1-3H3
InChIKeyYQJLOGWNJDHGBO-UHFFFAOYSA-N
MW239.41 g/mol
LogP1.40
Rot. Bonds7

About N-methyl-N-[2-[3-[(propan-2-ylamino)methyl]pyrrolidin-1-yl]ethyl]cyclopropanamine

N-methyl-N-[2-[3-[(propan-2-ylamino)methyl]pyrrolidin-1-yl]ethyl]cyclopropanamine (PubChem CID 62975746) has the molecular formula C14H29N3 and a molecular weight of 239.41 g/mol. Its IUPAC name is N-methyl-N-[2-[3-[(propan-2-ylamino)methyl]pyrrolidin-1-yl]ethyl]cyclopropanamine.

Molecular Properties

Compound NameN-methyl-N-[2-[3-[(propan-2-ylamino)methyl]pyrrolidin-1-yl]ethyl]cyclopropanamine
PubChem CID62975746
Molecular FormulaC14H29N3
Molecular Weight239.41 g/mol
Exact Mass239.24
IUPAC NameN-methyl-N-[2-[3-[(propan-2-ylamino)methyl]pyrrolidin-1-yl]ethyl]cyclopropanamine
SMILESCC(C)NCC1CCN(CCN(C)C2CC2)C1
InChIInChI=1S/C14H29N3/c1-12(2)15-10-13-6-7-17(11-13)9-8-16(3)14-4-5-14/h12-15H,4-11H2,1-3H3
InChIKeyYQJLOGWNJDHGBO-UHFFFAOYSA-N
XLogP1.40
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.41
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-methyl-N-[2-[3-[(propan-2-ylamino)methyl]pyrrolidin-1-yl]ethyl]cyclopropanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[2-[3-[(propan-2-ylamino)methyl]pyrrolidin-1-yl]ethyl]cyclopropanamine?
The IUPAC name of N-methyl-N-[2-[3-[(propan-2-ylamino)methyl]pyrrolidin-1-yl]ethyl]cyclopropanamine (CID 62975746) is N-methyl-N-[2-[3-[(propan-2-ylamino)methyl]pyrrolidin-1-yl]ethyl]cyclopropanamine.
What is the SMILES notation for N-methyl-N-[2-[3-[(propan-2-ylamino)methyl]pyrrolidin-1-yl]ethyl]cyclopropanamine?
The canonical SMILES for N-methyl-N-[2-[3-[(propan-2-ylamino)methyl]pyrrolidin-1-yl]ethyl]cyclopropanamine is CC(C)NCC1CCN(CCN(C)C2CC2)C1.
What is the InChIKey of N-methyl-N-[2-[3-[(propan-2-ylamino)methyl]pyrrolidin-1-yl]ethyl]cyclopropanamine?
The InChIKey is YQJLOGWNJDHGBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3/c1-12(2)15-10-13-6-7-17(11-13)9-8-16(3)14-4-5-14/h12-15H,4-11H2,1-3H3.
What are the key properties of N-methyl-N-[2-[3-[(propan-2-ylamino)methyl]pyrrolidin-1-yl]ethyl]cyclopropanamine?
N-methyl-N-[2-[3-[(propan-2-ylamino)methyl]pyrrolidin-1-yl]ethyl]cyclopropanamine has a molecular weight of 239.41 g/mol, XLogP of 1.40, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[2-[3-[(propan-2-ylamino)methyl]pyrrolidin-1-yl]ethyl]cyclopropanamine is sourced from PubChem (CID 62975746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).