2-(aminomethyl)-N-propan-2-yl-N-propylpyridin-4-amine

C12H21N3 — CID 62300700

IUPAC2-(aminomethyl)-N-propan-2-yl-N-propylpyridin-4-amine
SMILESCCCN(c1ccnc(CN)c1)C(C)C
InChIInChI=1S/C12H21N3/c1-4-7-15(10(2)3)12-5-6-14-11(8-12)9-13/h5-6,8,10H,4,7,9,13H2,1-3H3
InChIKeyRXFKCOMIPNVPOD-UHFFFAOYSA-N
MW207.32 g/mol
LogP2.17
Rot. Bonds5

About 2-(aminomethyl)-N-propan-2-yl-N-propylpyridin-4-amine

2-(aminomethyl)-N-propan-2-yl-N-propylpyridin-4-amine (PubChem CID 62300700) has the molecular formula C12H21N3 and a molecular weight of 207.32 g/mol. Its IUPAC name is 2-(aminomethyl)-N-propan-2-yl-N-propylpyridin-4-amine.

Molecular Properties

Compound Name2-(aminomethyl)-N-propan-2-yl-N-propylpyridin-4-amine
PubChem CID62300700
Molecular FormulaC12H21N3
Molecular Weight207.32 g/mol
Exact Mass207.17
IUPAC Name2-(aminomethyl)-N-propan-2-yl-N-propylpyridin-4-amine
SMILESCCCN(c1ccnc(CN)c1)C(C)C
InChIInChI=1S/C12H21N3/c1-4-7-15(10(2)3)12-5-6-14-11(8-12)9-13/h5-6,8,10H,4,7,9,13H2,1-3H3
InChIKeyRXFKCOMIPNVPOD-UHFFFAOYSA-N
XLogP2.17
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.32
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(aminomethyl)-N-butan-2-yl-N-methylpyridin-4-amine
CID 62300854
4-[propan-2-yl(propyl)amino]pyridine-2-carbonitrile
CID 62927034
2-(aminomethyl)-N,N-dibutylpyridin-4-amine
CID 62300849
N-pentyl-N-propan-2-yl-2-(propylaminomethyl)pyridin-4-amine
CID 62292935
2-(aminomethyl)-N-propan-2-yl-N-(thiophen-2-ylmethyl)pyridin-4-amine
CID 62286889
N'-(2-methyl-4-pyridinyl)-N'-propan-2-ylpropane-1,3-diamine
CID 112710088
4-(aminomethyl)-3-chloro-N-propan-2-yl-N-propylpyridin-2-amine
CID 107055104
N-[2-(aminomethyl)-4-pyridinyl]-N-methylmethanesulfonamide
CID 122468711
2-[(tert-butylamino)methyl]-N-(2-methoxyethyl)-N-propan-2-ylpyridin-4-amine
CID 82952467
2-(aminomethyl)-N-(2-methoxyethyl)-N-(2-methylpropyl)pyridin-4-amine
CID 62285332
N'-[2-(aminomethyl)-4-pyridinyl]-N,N,N'-trimethylpropane-1,3-diamine
CID 63695632
N-[[2-(aminomethyl)-4-pyridinyl]methyl]-N-ethylpropan-1-amine
CID 63887251

Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-N-propan-2-yl-N-propylpyridin-4-amine?
The IUPAC name of 2-(aminomethyl)-N-propan-2-yl-N-propylpyridin-4-amine (CID 62300700) is 2-(aminomethyl)-N-propan-2-yl-N-propylpyridin-4-amine.
What is the SMILES notation for 2-(aminomethyl)-N-propan-2-yl-N-propylpyridin-4-amine?
The canonical SMILES for 2-(aminomethyl)-N-propan-2-yl-N-propylpyridin-4-amine is CCCN(c1ccnc(CN)c1)C(C)C.
What is the InChIKey of 2-(aminomethyl)-N-propan-2-yl-N-propylpyridin-4-amine?
The InChIKey is RXFKCOMIPNVPOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3/c1-4-7-15(10(2)3)12-5-6-14-11(8-12)9-13/h5-6,8,10H,4,7,9,13H2,1-3H3.
What are the key properties of 2-(aminomethyl)-N-propan-2-yl-N-propylpyridin-4-amine?
2-(aminomethyl)-N-propan-2-yl-N-propylpyridin-4-amine has a molecular weight of 207.32 g/mol, XLogP of 2.17, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-N-propan-2-yl-N-propylpyridin-4-amine is sourced from PubChem (CID 62300700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).