3-methyl-N-propan-2-yl-N-(pyrrolidin-2-ylmethyl)pentan-2-amine

C14H30N2 — CID 106602821

IUPAC3-methyl-N-propan-2-yl-N-(pyrrolidin-2-ylmethyl)pentan-2-amine
SMILESCCC(C)C(C)N(CC1CCCN1)C(C)C
InChIInChI=1S/C14H30N2/c1-6-12(4)13(5)16(11(2)3)10-14-8-7-9-15-14/h11-15H,6-10H2,1-5H3
InChIKeyXDCQIQIZLIUGOB-UHFFFAOYSA-N
MW226.41 g/mol
LogP2.88
Rot. Bonds6

About 3-methyl-N-propan-2-yl-N-(pyrrolidin-2-ylmethyl)pentan-2-amine

3-methyl-N-propan-2-yl-N-(pyrrolidin-2-ylmethyl)pentan-2-amine (PubChem CID 106602821) has the molecular formula C14H30N2 and a molecular weight of 226.41 g/mol. Its IUPAC name is 3-methyl-N-propan-2-yl-N-(pyrrolidin-2-ylmethyl)pentan-2-amine.

Molecular Properties

Compound Name3-methyl-N-propan-2-yl-N-(pyrrolidin-2-ylmethyl)pentan-2-amine
PubChem CID106602821
Molecular FormulaC14H30N2
Molecular Weight226.41 g/mol
Exact Mass226.24
IUPAC Name3-methyl-N-propan-2-yl-N-(pyrrolidin-2-ylmethyl)pentan-2-amine
SMILESCCC(C)C(C)N(CC1CCCN1)C(C)C
InChIInChI=1S/C14H30N2/c1-6-12(4)13(5)16(11(2)3)10-14-8-7-9-15-14/h11-15H,6-10H2,1-5H3
InChIKeyXDCQIQIZLIUGOB-UHFFFAOYSA-N
XLogP2.88
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.41
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-propan-2-yl-N-(pyrrolidin-2-ylmethyl)butan-2-amine
CID 106603221
1-cyclopropyl-N-propan-2-yl-N-(pyrrolidin-2-ylmethyl)propan-1-amine
CID 106603245
3-methyl-N-propyl-N-(pyrrolidin-2-ylmethyl)pentan-2-amine
CID 106603765
4-methoxy-4-methyl-N-propan-2-yl-N-(pyrrolidin-2-ylmethyl)pentan-2-amine
CID 106602818
N-propan-2-yl-N-(pyrrolidin-2-ylmethyl)heptan-3-amine
CID 106602941
N-ethyl-N-(pyrrolidin-2-ylmethyl)propan-2-amine
CID 43265935
N-methyl-N-[[(2S)-pyrrolidin-2-yl]methyl]butan-2-amine
CID 104870141
2-[propan-2-yl(pyrrolidin-2-ylmethyl)amino]propanamide
CID 106614462
N-ethyl-3-methoxy-N-(pyrrolidin-2-ylmethyl)butan-2-amine
CID 106603489
1-(4-fluorophenyl)-N-propan-2-yl-N-(pyrrolidin-2-ylmethyl)propan-1-amine
CID 106602815
N-ethyl-N-(pyrrolidin-2-ylmethyl)butan-2-amine
CID 43274680
2-[piperidin-2-ylmethyl(propan-2-yl)amino]butanamide
CID 106632123

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-propan-2-yl-N-(pyrrolidin-2-ylmethyl)pentan-2-amine?
The IUPAC name of 3-methyl-N-propan-2-yl-N-(pyrrolidin-2-ylmethyl)pentan-2-amine (CID 106602821) is 3-methyl-N-propan-2-yl-N-(pyrrolidin-2-ylmethyl)pentan-2-amine.
What is the SMILES notation for 3-methyl-N-propan-2-yl-N-(pyrrolidin-2-ylmethyl)pentan-2-amine?
The canonical SMILES for 3-methyl-N-propan-2-yl-N-(pyrrolidin-2-ylmethyl)pentan-2-amine is CCC(C)C(C)N(CC1CCCN1)C(C)C.
What is the InChIKey of 3-methyl-N-propan-2-yl-N-(pyrrolidin-2-ylmethyl)pentan-2-amine?
The InChIKey is XDCQIQIZLIUGOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2/c1-6-12(4)13(5)16(11(2)3)10-14-8-7-9-15-14/h11-15H,6-10H2,1-5H3.
What are the key properties of 3-methyl-N-propan-2-yl-N-(pyrrolidin-2-ylmethyl)pentan-2-amine?
3-methyl-N-propan-2-yl-N-(pyrrolidin-2-ylmethyl)pentan-2-amine has a molecular weight of 226.41 g/mol, XLogP of 2.88, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-propan-2-yl-N-(pyrrolidin-2-ylmethyl)pentan-2-amine is sourced from PubChem (CID 106602821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).